%chk=000087317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087317

0 1
 O    1.603100     -9.1100000E-02   1.184500    
 O   -2.114900       2.218200     -0.7543000    
 O   -4.589800      0.1781000      0.3021000    
 O   -2.281600      -3.265500     -0.9339000    
 C   -2.294100     -0.1103000     -0.2478000    
 C   -1.722500      -1.280700      0.2511000    
 C  -0.2462000       1.085900      0.2128000    
 C   -1.555800       1.073100     -0.2671000    
 C   0.3183000     -8.4500000E-02  0.7091000    
 C  -0.4128000      -1.268000      0.7309000    
 C   -3.698100     -0.1206000     -0.7630000    
 C   -2.491900      -2.560900      0.2826000    
 C   0.5463000       2.353600      0.1933000    
 C    2.522300     -0.9607000      0.5338000    
 C    3.903400     -0.3937000      0.6364000    
 C    4.748400     -7.5999998E-02 -0.3626000    
 C   -2.807200       3.046100      0.1767000    
 C    6.112500      0.4838000     -5.5100001E-02
 C    4.460700     -0.2270000      -1.829500    
 H   3.0400001E-02  -2.178600       1.126000    
 H   -3.836000      0.6309000      -1.548800    
 H   -3.982000      -1.072500      -1.221000    
 H   -2.145600      -3.199900       1.102900    
 H   -3.564200      -2.423400      0.4482000    
 H   0.2649000       2.996300     -0.6475000    
 H   0.3931000       2.905600       1.126000    
 H    1.617700       2.159800      7.5300001E-02
 H    2.508200      -1.927300       1.051000    
 H    2.220100      -1.137500     -0.5023000    
 H    4.242500     -0.2356000       1.659700    
 H   -2.100500       3.730200      0.6557000    
 H   -3.326200       2.462700      0.9433000    
 H   -3.545000       3.637100     -0.3729000    
 H   -5.488300      0.1815000     -6.9799997E-02
 H   -2.275000      -2.630400      -1.669700    
 H    6.890700     -0.1690000     -0.4641000    
 H    6.223000       1.478200     -0.4999000    
 H    6.292300      0.5801000       1.020900    
 H    5.180200     -0.9170000      -2.283100    
 H    3.461800     -0.6073000      -2.049000    
 H    4.553200      0.7427000      -2.330500    


%chk=000087317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087317

0 1
O 1.667071 0.584538 0.098719
O -2.701806 2.563943 -0.328786
O -4.663088 -0.275900 0.784216
O -1.408328 -3.468219 -0.736886
C -2.529635 0.116453 -0.317586
C -1.715240 -1.041560 -0.206916
C -0.499444 1.553827 -0.100044
C -1.896837 1.392983 -0.233808
C 0.285062 0.365784 -0.027135
C -0.312205 -0.913513 -0.067394
C -4.020322 0.040398 -0.526508
C -2.315902 -2.442734 -0.190605
C 0.158882 2.914513 -0.043178
C 2.541628 -0.611389 0.237562
C 3.941796 -0.115313 0.457118
C 5.047622 -0.411238 -0.284870
C -3.318947 2.950049 0.960919
C 6.405157 0.155261 0.097658
C 5.061229 -1.304567 -1.512841
H 0.278177 -1.829435 0.019627
H -4.386623 1.012806 -0.905110
H -4.275761 -0.750886 -1.261783
H -2.497858 -2.772496 0.846461
H -3.290921 -2.467001 -0.716915
H -0.582205 3.707031 -0.229937
H 0.636915 3.085032 0.939880
H 0.965592 2.986693 -0.794311
H 2.188144 -1.197223 1.112692
H 2.446768 -1.243464 -0.665640
H 4.052984 0.550585 1.324008
H -2.538064 3.231161 1.694608
H -3.925513 2.118212 1.367525
H -3.954921 3.821262 0.738373
H -5.640276 -0.375301 0.639406
H -1.153680 -3.202079 -1.657219
H 7.135692 -0.655988 0.287704
H 6.820180 0.767777 -0.727096
H 6.349359 0.786387 1.000818
H 5.652788 -2.221772 -1.321395
H 4.056740 -1.614862 -1.842883
H 5.551190 -0.783355 -2.358048


